ChemSpider 2D Image | 4-(5-Bromo-2-iodobenzoyl)-3,3-dimethyl-2-piperazinone | C13H14BrIN2O2

4-(5-Bromo-2-iodobenzoyl)-3,3-dimethyl-2-piperazinone

  • Molecular FormulaC13H14BrIN2O2
  • Average mass437.071 Da
  • Monoisotopic mass435.928314 Da
  • ChemSpider ID43331079

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-Piperazinone, 4-(5-bromo-2-iodobenzoyl)-3,3-dimethyl- [ACD/Index Name]
4-(5-Brom-2-iodbenzoyl)-3,3-dimethyl-2-piperazinon [German] [ACD/IUPAC Name]
4-(5-Bromo-2-iodobenzoyl)-3,3-dimethyl-2-piperazinone [ACD/IUPAC Name]
4-(5-Bromo-2-iodobenzoyl)-3,3-diméthyl-2-pipérazinone [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.8±0.1 g/cm3
Boiling Point: 559.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.2±3.0 kJ/mol
Flash Point: 292.4±30.1 °C
Index of Refraction: 1.615
Molar Refractivity: 85.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.33
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 14.38
ACD/KOC (pH 5.5): 234.63
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 14.38
ACD/KOC (pH 7.4): 234.63
Polar Surface Area: 49 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 47.8±3.0 dyne/cm
Molar Volume: 243.7±3.0 cm3

Click to predict properties on the Chemicalize site


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